ChemSpider 2D Image | 2-{[(2-Chloroethyl)(nitroso)carbamoyl]amino}-2-deoxy-D-gulose | C9H16ClN3O7

2-{[(2-Chloroethyl)(nitroso)carbamoyl]amino}-2-deoxy-D-gulose

  • Molecular FormulaC9H16ClN3O7
  • Average mass313.692 Da
  • Monoisotopic mass313.067688 Da
  • ChemSpider ID62574883

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-{[(2-Chloroethyl)(nitroso)carbamoyl]amino}-2-deoxy-D-gulose [ACD/IUPAC Name]
2-{[(2-Chloroéthyl)(nitroso)carbamoyl]amino}-2-désoxy-D-gulose [French] [ACD/IUPAC Name]
D-Gulose, 2-[[[(2-chloroethyl)nitrosoamino]carbonyl]amino]-2-deoxy- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.603
Molar Refractivity: 64.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.72
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.98
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.76
Polar Surface Area: 160 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 70.0±7.0 dyne/cm
Molar Volume: 188.1±7.0 cm3

Click to predict properties on the Chemicalize site


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